SCHEMBL6453316

SCHEMBL6453316

C[C@H]1CC[C@H](C2CCC3CC(=O)CCC3C2)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SHBG P04278 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6453309 1.00 SHBG (0.32) SHBG
SCHEMBL6453311 1.00 SHBG (0.32) SHBG
SCHEMBL9924736 0.90 SHBG (0.33) SHBG
SCHEMBL4569183 0.87 SHBG (0.32) SHBG
SCHEMBL4572173 0.83 TLR4 (0.30)
SCHEMBL10861500 0.83 CA1 (0.32)
SCHEMBL10861505 0.83 CA1 (0.32)
SCHEMBL10286415 0.82
SCHEMBL6453332 0.79 TLR4 (0.38) SHBG
SCHEMBL6453335 0.79 TLR4 (0.38) SHBG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed